Dear all, Unfortunately I'm not really familiar with programming in Python (yet) but I've encountered a problem with MacPyMol in running the script that can be found here: http://cavanagh-lab.bch.ncsu.edu/bobay/intranet/pymol/data2bfactor.py
I've tried a couple of things to get the script running, and in the end I managed to narrow the problem down to the fact that the file that contains the data for the new b-factors is not imported correctly. I have made a text file, containing four columns that I've copied from excel; the Chain, the residue number, the residue name, and the b-factor. These columns are separated by tabs. In the script this code is used to determine the number of columns in my file: words = line.split() # check number of columns of data if len(words) == 4: etc Apparently, this is where it goes wrong because if I print the words variable. I get the total number 'words' in my input file instead of the number of columns... Does anybody know the solution to this problem? Cheers, Simon ------------------------------------------------------------------------------ Download Intel® Parallel Studio Eval Try the new software tools for yourself. Speed compiling, find bugs proactively, and fine-tune applications for parallel performance. See why Intel Parallel Studio got high marks during beta. http://p.sf.net/sfu/intel-sw-dev _______________________________________________ PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net) Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net